2-[4-(Ethylisopropylamino)phenylamino]-5-[(2-hydroxyethyl)methylamino][1,4]benzoquinone

HCID 89620643
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Basic information

Standard SMILES
CCN(c1ccc(NC2=CC(=O)C(N(C)CCO)=CC2=O)cc1)C(C)C
InChIKey
PPYANYILCVEBTF-UHFFFAOYSA-N
Molecular formula
C20H27N3O3
Average molar mass
357.4 g/mol

Names & identifiers

Preferred name
2-[4-(Ethylisopropylamino)phenylamino]-5-[(2-hydroxyethyl)methylamino][1,4]benzoquinone
IUPAC
2-[4-[ethyl(propan-2-yl)amino]anilino]-5-[2-hydroxyethyl(methyl)amino]cyclohexa-2,5-diene-1,4-dione

Names & synonyms

SCHEMBL15020239PPYANYILCVEBTF-UHFFFAOYSA-N2-[4-(ethylisopropylamino)phenylamino]-5-[(2-hydroxyethyl)methylamino][1,4]benzoquinone

Database identifiers

PubChem CID
89620643

Properties

Computed structural properties

XLogP
2.7
Topological polar surface area
72.9 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
6
Rotatable bonds
8
Heavy atoms
26

Related reactions

1 records
New reaction record

Compound notes

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